CID 6858012

Sodium (4-(dimethylamino)-2-methylphenyl)phosphinate

Structural Information

Molecular Formula
C9H12NO2P
SMILES
CC1=C(C=CC(=C1)N(C)C)P(=O)=O
InChI
InChI=1S/C9H12NO2P/c1-7-6-8(10(2)3)4-5-9(7)13(11)12/h4-6H,1-3H3
InChIKey
RQGQCGAOGULZGB-UHFFFAOYSA-N
Compound name
None
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

4
Patents

197.06056 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 198.06784 140.3
[M+Na]+ 220.04978 148.6
[M-H]- 196.05328 144.9
[M+NH4]+ 215.09438 161.0
[M+K]+ 236.02372 148.3
[M+H-H2O]+ 180.05782 132.1
[M+HCOO]- 242.05876 171.4
[M+CH3COO]- 256.07441 192.0
[M+Na-2H]- 218.03523 141.6
[M]+ 197.06001 143.9
[M]- 197.06111 143.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.